#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r4g s PRO 517 N 0.00 3.54 0.12 1.64 0.04 -1.26 -5.06 135.00 134.02 1r4g s PRO 517 Ca 0.00 1.51 -0.15 0.00 0.04 0.00 0.00 61.00 62.41 1r4g s PRO 517 Cb 0.00 -2.05 0.03 0.00 0.04 0.00 0.00 34.50 32.52 1r4g s PRO 517 CO 0.00 -0.67 0.36 0.95 0.04 0.00 0.00 177.00 177.68 1r4g s THR 518 N -1.85 0.08 0.53 1.26 -4.23 -1.26 -5.03 115.64 105.15 1r4g s THR 518 Ca 0.70 -0.69 0.27 0.00 -1.18 0.00 0.00 61.69 60.80 1r4g s THR 518 Cb -0.21 -1.21 0.42 0.00 1.34 0.00 0.00 72.50 72.84 1r4g s THR 518 CO 0.24 -0.37 1.97 0.24 -0.54 0.00 0.00 174.62 176.16 1r4g h MET 519 N 2.43 0.00 -0.33 3.99 2.86 -2.02 -0.30 114.93 121.56 1r4g h MET 519 Ca -0.34 0.00 0.10 0.00 -2.06 0.00 0.00 59.70 57.40 1r4g h MET 519 Cb 1.25 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.89 1r4g h MET 519 CO 0.48 0.00 0.29 0.45 1.06 0.00 0.00 176.91 179.20 1r4g h HIS 520 N 0.00 0.00 -0.28 -0.22 3.86 -1.99 -1.09 115.15 115.43 1r4g h HIS 520 Ca 0.29 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.49 1r4g h HIS 520 Cb 1.19 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.64 1r4g h HIS 520 CO 0.00 0.00 0.13 1.03 0.86 0.00 0.00 177.93 179.95 1r4g h SER 521 N 0.00 0.37 -0.52 2.45 0.87 -1.47 0.17 113.55 115.43 1r4g h SER 521 Ca 0.16 -0.13 -0.02 0.00 -1.23 0.00 0.00 61.79 60.57 1r4g h SER 521 Cb 0.74 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.59 1r4g h SER 521 CO -0.00 0.39 0.25 0.25 -0.53 0.00 0.00 176.83 177.19 1r4g h LEU 522 N 0.32 0.68 -0.51 2.23 5.85 -1.38 0.40 115.31 122.91 1r4g h LEU 522 Ca 0.10 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.71 1r4g h LEU 522 Cb 0.12 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 1r4g h LEU 522 CO -0.01 0.62 0.31 -0.09 -0.34 0.00 0.00 178.44 178.93 1r4g h ARG 523 N 0.69 0.61 -0.59 1.25 1.12 -1.18 -2.08 114.38 114.19 1r4g h ARG 523 Ca 0.18 -0.04 0.01 0.00 -1.11 0.00 0.00 59.98 59.02 1r4g h ARG 523 Cb 0.12 -0.14 -0.03 0.00 -0.01 0.00 0.00 29.97 29.91 1r4g h ARG 523 CO -0.02 0.40 0.39 1.25 -3.11 0.00 0.00 179.97 178.88 1r4g h LEU 524 N 0.63 0.67 -0.89 3.80 5.85 -0.12 -1.24 115.31 124.00 1r4g h LEU 524 Ca 0.20 -0.02 0.17 0.00 0.84 0.00 0.00 57.88 59.07 1r4g h LEU 524 Cb -0.01 -0.17 -0.10 0.00 0.37 0.00 0.00 40.66 40.75 1r4g h LEU 524 CO -0.07 0.48 0.46 0.58 -0.34 0.00 0.00 178.44 179.55 1r4g h VAL 525 N 0.80 0.67 -0.15 1.05 2.07 -0.28 0.33 116.25 120.73 1r4g h VAL 525 Ca 0.22 -0.21 -0.06 0.00 0.82 0.00 0.00 66.70 67.48 1r4g h VAL 525 Cb -0.08 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 29.70 1r4g h VAL 525 CO -0.05 0.11 -0.13 0.40 0.02 0.00 0.00 177.57 177.92 1r4g h ILE 526 N 0.60 1.33 -0.49 4.57 1.08 -0.76 -1.32 117.51 122.52 1r4g h ILE 526 Ca 0.51 -1.25 0.01 0.00 -0.39 0.00 0.00 64.86 63.73 1r4g h ILE 526 Cb 0.79 1.82 -0.02 0.00 -3.07 0.00 0.00 36.82 36.33 1r4g h ILE 526 CO -0.40 0.37 0.33 -0.33 -0.69 0.00 0.00 178.15 177.42 1r4g h GLU 527 N 0.00 0.64 -0.38 2.37 4.39 0.00 -1.76 114.58 119.84 1r4g h GLU 527 Ca 0.03 -0.04 -0.07 0.00 0.34 0.00 0.00 59.36 59.62 1r4g h GLU 527 Cb 0.64 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 1r4g h GLU 527 CO 0.03 0.43 -0.03 0.77 -1.16 0.00 0.00 179.01 179.05 1r4g h SER 528 N 0.66 0.69 -3.38 1.42 0.02 -0.27 -3.43 113.55 109.26 1r4g h SER 528 Ca 0.18 -0.33 -0.52 0.00 -0.84 0.00 0.00 61.79 60.28 1r4g h SER 528 Cb -0.07 -0.19 0.04 0.00 0.14 0.00 0.00 62.40 62.33 1r4g h SER 528 CO -0.04 0.85 0.71 -0.44 -1.14 0.00 0.00 176.83 176.77 1r4g s SER 529 N -6.23 6.78 -1.15 3.07 0.01 -0.51 -4.90 113.70 110.76 1r4g s SER 529 Ca -0.13 2.53 -0.08 0.00 1.31 0.00 0.00 55.95 59.59 1r4g s SER 529 Cb 0.10 -2.62 -0.10 0.00 0.21 0.00 0.00 66.02 63.61 1r4g s SER 529 CO 0.80 -0.61 2.72 -0.81 0.41 0.00 0.00 173.24 175.74 1r4g n PRO 530 N 2.49 2.88 -0.31 12.44 -0.04 -1.26 -4.89 135.00 146.30 1r4g n PRO 530 Ca 0.06 -1.75 -0.13 0.00 -0.04 0.00 0.00 63.50 61.64 1r4g n PRO 530 Cb 0.41 -2.55 0.12 0.00 -0.04 0.00 0.00 33.50 31.44 1r4g n PRO 530 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1r4g n LEU 531 N 3.63 0.00 0.00 1.53 4.32 -1.26 -5.07 117.00 120.14 1r4g n LEU 531 Ca 0.61 -0.46 0.00 0.00 -0.02 0.00 0.00 56.01 56.15 1r4g n LEU 531 Cb 0.28 -0.44 0.00 0.00 -1.62 0.00 0.00 43.42 41.64 1r4g n LEU 531 CO 0.70 -1.75 0.00 -1.20 -1.22 0.00 0.00 177.39 173.92 1r4g n SER 532 N -3.99 0.00 -0.08 -1.43 7.64 -1.26 -4.93 113.62 109.57 1r4g n SER 532 Ca 0.06 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.84 1r4g n SER 532 Cb 0.26 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.41 1r4g n SER 532 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1r4g h ARG 533 N 0.00 0.00 -0.43 1.43 9.65 -1.97 -3.37 114.38 119.70 1r4g h ARG 533 Ca 0.00 0.00 -0.08 0.00 -1.10 0.00 0.00 59.98 58.80 1r4g h ARG 533 Cb 0.00 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.57 1r4g h ARG 533 CO 0.00 0.34 -0.03 0.00 2.80 0.00 0.00 179.97 183.07 1r4g h ALA 534 N -0.83 0.58 -0.15 2.80 0.00 -1.97 -1.24 119.26 118.44 1r4g h ALA 534 Ca -0.12 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 1r4g h ALA 534 Cb 0.77 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1r4g h ALA 534 CO -0.07 0.40 0.03 0.93 0.00 0.00 0.00 179.25 180.54 1r4g h GLU 535 N 0.61 0.24 0.11 0.00 5.08 -1.93 0.14 114.58 118.83 1r4g h GLU 535 Ca 0.12 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1r4g h GLU 535 Cb 0.54 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 1r4g h GLU 535 CO 0.03 0.40 -0.07 -0.22 -1.00 0.00 0.00 179.01 178.15 1r4g h LYS 536 N 0.05 -0.16 0.12 2.33 3.64 -1.71 -0.84 116.57 119.99 1r4g h LYS 536 Ca 0.05 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1r4g h LYS 536 Cb 0.27 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.09 1r4g h LYS 536 CO 0.00 -0.11 -0.28 0.00 -2.27 0.00 0.00 179.45 176.79 1r4g h ALA 537 N 0.72 -0.48 -0.24 5.00 0.00 -1.13 0.62 119.26 123.74 1r4g h ALA 537 Ca -0.01 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1r4g h ALA 537 Cb 0.14 0.46 -0.07 0.00 0.00 0.00 0.00 17.79 18.32 1r4g h ALA 537 CO 0.01 -0.82 -0.28 0.00 0.00 0.00 0.00 179.25 178.16 1r4g h ALA 538 N 0.20 -0.21 0.17 0.00 0.00 -0.55 0.10 119.26 118.98 1r4g h ALA 538 Ca 0.03 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1r4g h ALA 538 Cb 0.53 0.58 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1r4g h ALA 538 CO -0.16 -0.72 -0.08 -0.92 0.00 0.00 0.00 179.25 177.37 1r4g h TYR 539 N -0.29 -0.21 -0.79 0.00 3.20 -0.94 -1.03 116.97 116.90 1r4g h TYR 539 Ca 0.13 -0.00 0.18 0.00 3.14 0.00 0.00 58.73 62.18 1r4g h TYR 539 Cb 0.50 0.07 -0.12 0.00 1.54 0.00 0.00 36.73 38.72 1r4g h TYR 539 CO -0.43 -0.11 0.21 0.28 -1.64 0.00 0.00 178.16 176.47 1r4g h VAL 540 N -0.25 0.46 -0.01 1.81 2.07 -0.31 0.26 116.25 120.28 1r4g h VAL 540 Ca -0.02 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 1r4g h VAL 540 Cb 0.20 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.13 1r4g h VAL 540 CO 0.04 0.05 0.00 0.11 0.02 0.00 0.00 177.57 177.79 1r4g h LYS 541 N 0.27 0.01 -0.92 1.57 6.56 -0.45 -1.22 116.57 122.39 1r4g h LYS 541 Ca 0.46 -0.00 0.05 0.00 -1.06 0.00 0.00 60.65 60.10 1r4g h LYS 541 Cb 0.83 -0.00 -0.06 0.00 -0.57 0.00 0.00 32.23 32.43 1r4g h LYS 541 CO -0.55 0.14 0.60 0.66 -2.06 0.00 0.00 179.45 178.24 1r4g h SER 542 N -0.12 0.96 -0.27 0.86 4.64 0.32 -1.57 113.55 118.37 1r4g h SER 542 Ca 0.00 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1r4g h SER 542 Cb 0.13 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.00 1r4g h SER 542 CO -0.00 0.64 0.11 0.25 -0.87 0.00 0.00 176.83 176.96 1r4g h LEU 543 N 1.10 0.37 -1.90 5.97 5.85 -0.36 -2.33 115.31 124.02 1r4g h LEU 543 Ca 0.38 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 1r4g h LEU 543 Cb 0.10 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 1r4g h LEU 543 CO -0.13 0.43 -0.06 0.77 -0.34 0.00 0.00 178.44 179.10 1r4g h SER 544 N 0.29 0.00 0.00 1.25 4.64 -0.51 -2.08 113.55 117.14 1r4g h SER 544 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1r4g h SER 544 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1r4g h SER 544 CO -0.01 0.06 0.00 1.17 -0.87 0.00 0.00 176.83 177.19 1r4g n LYS 545 N -4.41 0.30 -0.37 4.77 3.00 -0.66 -4.84 118.16 115.95 1r4g n LYS 545 Ca -0.03 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 58.00 1r4g n LYS 545 Cb 0.14 -1.20 0.26 0.00 0.00 0.00 0.00 35.03 34.24 1r4g n LYS 545 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1r4g n LYS 547 N -4.89 0.00 0.00 0.00 3.00 -1.26 -5.10 118.16 109.90 1r4g n LYS 547 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.39 1r4g n LYS 547 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.59 1r4g n LYS 547 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1r4g n THR 548 N -2.63 0.00 0.00 3.15 -1.04 -1.26 -5.11 114.28 107.39 1r4g n THR 548 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1r4g n THR 548 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1r4g n THR 548 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1r4g n ASP 549 N 0.00 0.00 -0.20 8.00 5.75 -1.26 -4.81 116.55 124.03 1r4g n ASP 549 Ca 0.00 0.00 0.09 0.00 -0.01 0.00 0.00 54.79 54.87 1r4g n ASP 549 Cb 0.00 0.24 0.39 0.00 -1.03 0.00 0.00 41.12 40.72 1r4g n ASP 549 CO 0.00 0.00 0.00 1.56 -0.11 0.00 0.00 177.20 178.65 1r4g h GLN 550 N 0.00 0.66 -0.02 0.11 4.20 -1.99 0.85 115.11 118.91 1r4g h GLN 550 Ca 0.00 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1r4g h GLN 550 Cb 0.00 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.63 1r4g h GLN 550 CO 0.00 0.43 -0.03 1.05 -0.67 0.00 0.00 178.83 179.61 1r4g h GLU 551 N 0.68 0.06 -0.83 1.46 4.11 -1.99 -2.31 114.58 115.76 1r4g h GLU 551 Ca 0.36 -0.04 -0.01 0.00 0.07 0.00 0.00 59.36 59.74 1r4g h GLU 551 Cb 0.49 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.70 1r4g h GLU 551 CO -0.13 0.58 0.47 0.28 0.07 0.00 0.00 179.01 180.28 1r4g h VAL 552 N -0.46 1.24 -0.35 -1.06 2.07 -1.64 0.70 116.25 116.75 1r4g h VAL 552 Ca 0.00 -0.57 -0.13 0.00 0.82 0.00 0.00 66.70 66.82 1r4g h VAL 552 Cb 0.58 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1r4g h VAL 552 CO 0.01 0.26 -0.30 0.07 0.02 0.00 0.00 177.57 177.63 1r4g h LYS 553 N 1.15 0.76 -0.88 1.57 5.09 -0.92 0.54 116.57 123.87 1r4g h LYS 553 Ca 0.29 -0.35 0.01 0.00 0.09 0.00 0.00 60.65 60.70 1r4g h LYS 553 Cb 0.00 -0.01 -0.04 0.00 0.10 0.00 0.00 32.23 32.27 1r4g h LYS 553 CO -0.05 0.96 0.59 0.00 -2.09 0.00 0.00 179.45 178.86 1r4g h ALA 554 N 1.01 1.37 -0.50 0.07 0.00 -0.75 0.51 119.26 120.98 1r4g h ALA 554 Ca 0.07 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1r4g h ALA 554 Cb 0.83 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1r4g h ALA 554 CO 0.07 0.58 0.01 0.28 0.00 0.00 0.00 179.25 180.19 1r4g h VAL 555 N 1.19 1.25 -0.37 0.00 2.07 -0.03 0.15 116.25 120.50 1r4g h VAL 555 Ca 0.33 -1.02 -0.02 0.00 0.82 0.00 0.00 66.70 66.81 1r4g h VAL 555 Cb -0.13 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1r4g h VAL 555 CO -0.07 0.36 0.16 0.24 0.02 0.00 0.00 177.57 178.28 1r4g h MET 556 N 0.78 0.55 -0.99 1.57 2.86 0.73 0.43 114.93 120.87 1r4g h MET 556 Ca 0.15 -0.09 0.05 0.00 -2.06 0.00 0.00 59.70 57.75 1r4g h MET 556 Cb 0.46 -0.09 -0.06 0.00 0.06 0.00 0.00 31.60 31.97 1r4g h MET 556 CO 0.02 0.52 0.64 0.93 1.06 0.00 0.00 176.91 180.08 1r4g h GLU 557 N 0.46 1.18 -0.69 1.72 5.08 -0.57 0.51 114.58 122.26 1r4g h GLU 557 Ca 0.13 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1r4g h GLU 557 Cb 0.16 -0.27 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 1r4g h GLU 557 CO -0.01 0.78 0.45 1.25 -1.00 0.00 0.00 179.01 180.48 1r4g h LEU 558 N 1.21 0.74 -0.45 1.33 5.85 0.35 -1.26 115.31 123.07 1r4g h LEU 558 Ca 0.41 -0.01 0.08 0.00 0.84 0.00 0.00 57.88 59.19 1r4g h LEU 558 Cb 0.07 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 40.86 1r4g h LEU 558 CO -0.15 0.52 0.07 0.58 -0.34 0.00 0.00 178.44 179.12 1r4g h VAL 559 N 0.86 0.73 0.64 1.05 2.07 0.12 0.21 116.25 121.94 1r4g h VAL 559 Ca 0.27 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.70 1r4g h VAL 559 Cb 0.01 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 1r4g h VAL 559 CO -0.07 0.04 -0.47 -0.33 0.02 0.00 0.00 177.57 176.76 1r4g h GLU 560 N 0.19 -1.03 -0.06 1.57 5.08 -1.04 -2.55 114.58 116.75 1r4g h GLU 560 Ca 0.22 0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.60 1r4g h GLU 560 Cb 0.30 0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1r4g h GLU 560 CO -0.31 -0.68 -0.20 1.05 -1.00 0.00 0.00 179.01 177.86 1r4g h GLU 561 N -1.07 0.10 -0.38 2.33 -0.00 -1.27 -2.72 114.58 111.56 1r4g h GLU 561 Ca -0.08 -0.02 0.02 0.00 -0.00 0.00 0.00 59.36 59.28 1r4g h GLU 561 Cb 0.88 -0.01 -0.03 0.00 -0.00 0.00 0.00 28.75 29.59 1r4g h GLU 561 CO 0.04 0.30 0.20 0.22 -0.00 0.00 0.00 179.01 179.77 1r4g h ASP 562 N 0.09 0.31 0.28 3.06 3.58 -0.41 0.12 116.42 123.45 1r4g h ASP 562 Ca 0.02 0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.47 1r4g h ASP 562 Cb 0.42 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.41 1r4g h ASP 562 CO 0.03 0.23 -0.20 0.40 -2.88 0.00 0.00 179.24 176.82 1r4g h ILE 563 N 0.42 0.58 0.00 2.25 1.08 -1.15 0.22 117.51 120.90 1r4g h ILE 563 Ca 0.16 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.63 1r4g h ILE 563 Cb 0.05 0.58 0.00 0.00 -3.07 0.00 0.00 36.82 34.38 1r4g h ILE 563 CO -0.10 0.00 0.00 -0.62 -0.69 0.00 0.00 178.15 176.74 1r4g n GLU 564 N -5.32 0.10 -0.10 2.37 -0.58 -0.81 0.11 120.64 116.41 1r4g n GLU 564 Ca -0.09 0.18 -0.15 0.00 -0.42 0.00 0.00 57.16 56.67 1r4g n GLU 564 Cb 0.23 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.55 1r4g n GLU 564 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1r4g n SER 565 N -1.21 1.83 0.07 1.62 2.88 0.36 -4.63 113.62 114.55 1r4g n SER 565 Ca 0.03 0.31 -0.08 0.00 -1.33 0.00 0.00 58.87 57.80 1r4g n SER 565 Cb 0.04 -0.72 0.04 0.00 -0.75 0.00 0.00 64.21 62.82 1r4g n SER 565 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1r4g h LEU 566 N -0.91 0.34 0.00 2.46 3.38 -0.56 -3.47 115.31 116.54 1r4g h LEU 566 Ca -0.23 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1r4g h LEU 566 Cb 1.14 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1r4g h LEU 566 CO -0.14 0.97 0.00 0.41 0.09 0.00 0.00 178.44 179.77 1r4g n THR 567 N -3.78 0.00 -1.47 0.22 -1.04 0.12 -5.08 114.28 103.25 1r4g n THR 567 Ca -0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 1r4g n THR 567 Cb 0.72 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.23 1r4g n THR 567 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02